4-[6-(methoxymethyl)-2-phenylpyrimidin-4-yl]morpholine

C16H19N3O2 — CID 1476663

IUPAC4-[6-(methoxymethyl)-2-phenylpyrimidin-4-yl]morpholine
SMILESCOCc1cc(N2CCOCC2)nc(-c2ccccc2)n1
InChIInChI=1S/C16H19N3O2/c1-20-12-14-11-15(19-7-9-21-10-8-19)18-16(17-14)13-5-3-2-4-6-13/h2-6,11H,7-10,12H2,1H3
InChIKeySIDWOAWDWORYHF-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.13
Rot. Bonds4

About 4-[6-(methoxymethyl)-2-phenylpyrimidin-4-yl]morpholine

4-[6-(methoxymethyl)-2-phenylpyrimidin-4-yl]morpholine (PubChem CID 1476663) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 4-[6-(methoxymethyl)-2-phenylpyrimidin-4-yl]morpholine.

Molecular Properties

Compound Name4-[6-(methoxymethyl)-2-phenylpyrimidin-4-yl]morpholine
PubChem CID1476663
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name4-[6-(methoxymethyl)-2-phenylpyrimidin-4-yl]morpholine
SMILESCOCc1cc(N2CCOCC2)nc(-c2ccccc2)n1
InChIInChI=1S/C16H19N3O2/c1-20-12-14-11-15(19-7-9-21-10-8-19)18-16(17-14)13-5-3-2-4-6-13/h2-6,11H,7-10,12H2,1H3
InChIKeySIDWOAWDWORYHF-UHFFFAOYSA-N
XLogP2.13
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[6-(methoxymethyl)-2-phenylpyrimidin-4-yl]morpholine?
The IUPAC name of 4-[6-(methoxymethyl)-2-phenylpyrimidin-4-yl]morpholine (CID 1476663) is 4-[6-(methoxymethyl)-2-phenylpyrimidin-4-yl]morpholine.
What is the SMILES notation for 4-[6-(methoxymethyl)-2-phenylpyrimidin-4-yl]morpholine?
The canonical SMILES for 4-[6-(methoxymethyl)-2-phenylpyrimidin-4-yl]morpholine is COCc1cc(N2CCOCC2)nc(-c2ccccc2)n1.
What is the InChIKey of 4-[6-(methoxymethyl)-2-phenylpyrimidin-4-yl]morpholine?
The InChIKey is SIDWOAWDWORYHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-20-12-14-11-15(19-7-9-21-10-8-19)18-16(17-14)13-5-3-2-4-6-13/h2-6,11H,7-10,12H2,1H3.
What are the key properties of 4-[6-(methoxymethyl)-2-phenylpyrimidin-4-yl]morpholine?
4-[6-(methoxymethyl)-2-phenylpyrimidin-4-yl]morpholine has a molecular weight of 285.35 g/mol, XLogP of 2.13, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-(methoxymethyl)-2-phenylpyrimidin-4-yl]morpholine is sourced from PubChem (CID 1476663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).